BIOMOLECULE: 1 THIS ENTRY CONTAINS THE CRYSTALLOGRAPHIC ASYMMETRIC UNIT WHICH CONSISTS OF 1 ... BIOMOLECULE: 1 THIS ENTRY CONTAINS THE CRYSTALLOGRAPHIC ASYMMETRIC UNIT WHICH CONSISTS OF 1 CHAIN(S). AUTHORS STATE THAT THE BIOLOGICAL UNIT OF THIS PROTEIN IS UNKNOWN AT THE TIME OF DEPOSITION.
解像度: 1.8→1.84 Å / 冗長度: 7.4 % / Rmerge(I) obs: 0.78 / Mean I/σ(I) obs: 2.11 / Num. unique all: 1801 / Rsym value: 0.78 / % possible all: 99.6
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解析
ソフトウェア
名称
バージョン
分類
REFMAC
5.2.0019
精密化
CBASS
データ収集
HKL-2000
データ削減
HKL-2000
データスケーリング
SOLVE
位相決定
RESOLVE
位相決定
精密化
構造決定の手法: 単波長異常分散 / 解像度: 1.8→29.93 Å / Cor.coef. Fo:Fc: 0.951 / Cor.coef. Fo:Fc free: 0.927 / SU B: 2.217 / SU ML: 0.07 / 交差検証法: THROUGHOUT / σ(F): 0 / σ(I): 0 / ESU R: 0.096 / ESU R Free: 0.1 / 立体化学のターゲット値: MAXIMUM LIKELIHOOD 詳細: HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS. SOLVE/RESOLVE 2.12, COOT 0.1.2 PROGRAMS WERE ALSO USED IN REFINEMENT
Rfactor
反射数
%反射
Selection details
Rfree
0.24099
943
5.1 %
RANDOM
Rwork
0.20537
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all
0.20709
17497
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obs
0.20709
17497
99.83 %
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溶媒の処理
イオンプローブ半径: 0.8 Å / 減衰半径: 0.8 Å / VDWプローブ半径: 1.4 Å / 溶媒モデル: MASK